Geometry & MOs

Info

ID:	248840
PubChem CID:	103084877
Reduced:	ON5C11H15 (1)
Stoich.:	AB5C11D15 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	58.27
Dipole, Da:	4.95
IP(EA), eV:	-9.31(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(3-methoxyphenyl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C2=CC(=CC=C2)OC)NC

DOS

IR

Vibrations